Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28046922 | 0.83 | GAA (0.44) | GAACYP2C19ALDH1A1MAPTHSD17B10 | |
| SCHEMBL13653517 | 0.80 | GAA (0.51) | GAAALDH1A1MAPTLMNAHSD17B10 | |
| SCHEMBL4817806 | 0.80 | HPGD (0.53) | ALDH1A1MAPTLMNAHSD17B10POLB | |
| SCHEMBL12497355 | 0.80 | KDM4E (0.47) | GAACYP2C19ALDH1A1MAPTHSD17B10 | |
| SCHEMBL10952765 | 0.75 | NPSR1 (0.53) | GAAALDH1A1MAPTHSD17B10 | |
| SCHEMBL10953163 | 0.75 | ALDH1A1 (0.49) | GAAALDH1A1MAPTLMNAHSD17B10 | |
| SCHEMBL15483137 | 0.74 | LMNA (0.41) | GAAALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL3726558 | 0.74 | ALDH1A1 (0.53) | GAAALDH1A1MAPTLMNAHSD17B10 | |
| SCHEMBL8458715 | 0.71 | ALDH1A1 (0.46) | GAAALDH1A1MAPTLMNAHSD17B10 | |
| SCHEMBL16766556 | 0.71 | PTK2 (0.38) | GAACYP2C19MAPTTSHRPOLB |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105120860-B | Histone deacetylase inhibitors | 生物马林药物股份有限公司 | 2021-01-26 | — | — | CN | disclosed |
| CN-111747948-A | Histone deacetylase inhibitors | 生物马林药物股份有限公司 | 2020-10-09 | — | — | CN | disclosed |